In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 16 | Yes |
Popular Name: (2S)-N1,N1-diethyl-N2-(6-methylpyridazin-3-yl)propane-1,2-diamine (2S)-N1,N1-diethyl-N2-(6-methylp…
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Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.55 | 6.44 | -39.97 | 2 | 4 | 1 | 42 | 223.344 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.55 | 4.21 | -7.6 | 1 | 4 | 0 | 41 | 222.336 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.55 | 6.55 | -83.26 | 3 | 4 | 2 | 43 | 224.352 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.55 | 6.6 | -89.79 | 3 | 4 | 2 | 43 | 224.352 | 6 | ↓ |